2-[[(2-azanyl-2-sulfanylidene-ethanethioyl)amino]methylidene]-3-oxidanylidene-N-phenyl-butanamide

Systemtic Name: 2-[[(2-azanyl-2-sulfanylidene-ethanethioyl)amino]methylidene]-3-oxidanylidene-N-phenyl-butanamide Openeye Name: 2-[[(2-amino-2-thioxo-ethanethioyl)amino]methylene]-3-oxo-N-phenyl-butanamide CAS Name: 2-[[[2-amino-1,2-bis(sulfanylidene)ethyl]amino]methylidene]-3-oxo-N-phenylbutanamide IUPAC Name: 2-[[(2-amino-2-sulfanylideneethanethioyl)amino]methylidene]-3-oxo-N-phenylbutanamide Traditional Name: 2-acetyl-3-[(2-amino-2-thioxo-thioacetyl)amino]-N-phenyl-acrylamide Formula: C13H13N3O2S2 MolecularWeight: 307.39122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CNC(=S)C(=S)N)C(=O)NC1=CC=CC=C1

Isomeric SMILES

CC(=O)C(=CNC(=S)C(=S)N)C(=O)NC1=CC=CC=C1

InChI

InChI=1S/C13H13N3O2S2/c1-8(17)10(7-15-13(20)11(14)19)12(18)16-9-5-3-2-4-6-9/h2-7H,1H3,(H2,14,19)(H,15,20)(H,16,18)